General Information of the Compound
Compound ID |
CP0434349
|
||||||||||||||||||
---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Compound Name |
6-[(4-(4-phenylpiperazin-1-yl)butyl)(propyl)amino]-5,6,7,8-tetrahydronaphthalene-2,3-diol
Show/Hide
|
||||||||||||||||||
Structure |
|
||||||||||||||||||
Formula |
C27H39N3O2
|
||||||||||||||||||
Molecular Weight |
437.628
|
||||||||||||||||||
Canonical SMILES |
CCCN(CCCCN1CCN(CC1)c1ccccc1)C1CCc2cc(O)c(O)cc2C1
Show/Hide
|
||||||||||||||||||
InChI |
InChI=1S/C27H39N3O2/c1-2-12-29(25-11-10-22-20-26(31)27(32)21-23(22)19-25)14-7-6-13-28-15-17-30(18-16-28)24-8-4-3-5-9-24/h3-5,8-9,20-21,25,31-32H,2,6-7,10-19H2,1H3
Show/Hide
|
||||||||||||||||||
InChIKey |
BTNRAFHTPKZOBC-UHFFFAOYSA-N
|
||||||||||||||||||
Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
|
||||||||||||||||||
Click to Show/Hide the External Link(s) of This Compound | |||||||||||||||||||
PubChem ID | |||||||||||||||||||
ChEMBL ID |
Map of Molecular Bioactivity Related to the Compound
Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
|
---|
Table of Molecular Bioactivities Related to the Compound
Protein ID: PT01005, D(2) dopamine receptor
Protein ID: PT00943, D(3) dopamine receptor